methyl 2-[[2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate

Systemtic Name: methyl 2-[[2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate Openeye Name: methyl 2-[[2-cyano-2-[4-(4-nitrophenyl)thiazol-2-yl]vinyl]amino]benzoate CAS Name: 2-[[2-cyano-2-[4-(4-nitrophenyl)-2-thiazolyl]ethenyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate Traditional Name: 2-[[2-cyano-2-[4-(4-nitrophenyl)thiazol-2-yl]vinyl]amino]benzoic acid methyl ester Formula: C20H14N4O4S MolecularWeight: 406.41456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O4S/c1-28-20(25)16-4-2-3-5-17(16)22-11-14(10-21)19-23-18(12-29-19)13-6-8-15(9-7-13)24(26)27/h2-9,11-12,22H,1H3